3-[[3-methyl-4-(methylsulfonylamino)phenyl]sulfamoyl]propanoic acid

Systemtic Name: 3-[[3-methyl-4-(methylsulfonylamino)phenyl]sulfamoyl]propanoic acid Openeye Name: 3-[[4-(methanesulfonamido)-3-methyl-phenyl]sulfamoyl]propanoic acid CAS Name: 3-[[4-(methanesulfonamido)-3-methylphenyl]sulfamoyl]propanoic acid IUPAC Name: 3-[[4-(methanesulfonamido)-3-methylphenyl]sulfamoyl]propanoic acid Traditional Name: 3-[[4-(methanesulfonamido)-3-methyl-phenyl]sulfamoyl]propionic acid Formula: C11H16N2O6S2 MolecularWeight: 336.38454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NS(=O)(=O)CCC(=O)O)NS(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)NS(=O)(=O)CCC(=O)O)NS(=O)(=O)C

InChI

InChI=1S/C11H16N2O6S2/c1-8-7-9(3-4-10(8)13-20(2,16)17)12-21(18,19)6-5-11(14)15/h3-4,7,12-13H,5-6H2,1-2H3,(H,14,15)